Thionine acetate
TL;DR: Thionine acetate (CAS 78338-22-4) is a chemical compound with molecular formula C14H13N3O2S and molecular weight 287.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7-aminophenothiazin-3-ylidene)azanium acetate
Also Known As: Thionin acetate, thionine acetate, Thionin acetate salt, Thioninacetat, Thionin
| Molecular Formula | C14H13N3O2S |
|---|---|
| Molecular Weight | 287.07 g/mol |
| LogP | -0.6007 |
| Topological Polar Surface Area | 104.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 287.07285 |
| Heavy Atoms | 20 |
| Complexity | 793.96173 |
Chemical Identifiers
| CAS Number | 78338-22-4 |
|---|---|
| SMILES | CC(=O)[O-].C1=CC2=C(C=C1N)SC3=CC(=[NH2+])C=CC3=N2 |
Product Overview
Thionine acetate (CAS 78338-22-4), with molecular formula C14H13N3O2S and molecular weight 287.07 g/mol. IUPAC: (7-aminophenothiazin-3-ylidene)azanium acetate.
Chemical Property Profile of Thionine acetate
Property Insights of Thionine acetate
The XLogP value of -0.6007 indicates that Thionine acetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 104.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Thionine acetate. Following Lipinski's Rule of Five, Thionine acetate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Thionine acetate?
The CAS number of Thionine acetate is 78338-22-4.
What is the molecular formula of Thionine acetate?
The molecular formula of Thionine acetate is C14H13N3O2S.
What is the molecular weight of Thionine acetate?
The molecular weight of Thionine acetate is 287.07 g/mol.
Where can I buy Thionine acetate?
You can request a quote for Thionine acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thionine acetate?
Yes, KEHONG BIO provides custom synthesis services for Thionine acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.